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3-(Propa-1',2'-dien-1'-yl)cyclododeca-1-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

3-(Propa-1',2'-dien-1'-yl)cyclododeca-1-one
SpectraBase Compound ID Iu2JwpXdcpD
InChI InChI=1S/C15H24O/c1-2-10-14-11-8-6-4-3-5-7-9-12-15(16)13-14/h10,14H,1,3-9,11-13H2
InChIKey SVBNKNBPYBJBMM-UHFFFAOYSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6OCd2PopbKk
Name 3-(Propa-1',2'-dien-1'-yl)cyclododeca-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-2-10-14-11-8-6-4-3-5-7-9-12-15(16)13-14/h10,14H,1,3-9,11-13H2
InChIKey SVBNKNBPYBJBMM-UHFFFAOYSA-N
Molecular Weight 220.356 g/mol
SMILES C(=C=C)C1CC(=O)CCCCCCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.964394